{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5539988 -2.9494352 -4.251969 ] [ 6.1638969 3.4464863 3.0502129 ] [ -2.3588968 2.4177246 -2.0721212 ] [ -2.0766154 1.1766377 0.9374775 ] [ -2.4009888 -1.5916337 -6.0869715 ] [ 6.8154495 -2.5154355 -2.0899762 ] [ -3.236567 2.1294436 8.4771907 ] [ 0.6477205 -2.1137878 2.0361568 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.694133834624039e-09 -4.725516160937117e-09 -6.812405380292345e-09 ] [ 9.875651587565034e-09 5.521879819261114e-09 4.886979837105378e-09 ] [ -3.779369334977371e-09 3.873621861566996e-09 -3.319904169456041e-09 ] [ -3.327104671684563e-09 1.885181429623502e-09 1.502004545400735e-09 ] [ -3.846808153855699e-09 -2.550078324026966e-09 -9.75240350912393e-09 ] [ 1.091955393910698e-08 -4.030171982434107e-09 -3.348511033256111e-09 ] [ -5.185552021775477e-09 3.411744779340842e-09 1.35819568615021e-08 ] [ 1.037762650462797e-09 -3.386661422394265e-09 3.262282848120211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.357442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.504669077641022e-18 } }